input word = C00012879

Metabolite InformationStructural formula
Name (+)-Isoalloalantolactone
Isoalloalantolactone
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
Formula C15H20O2
Mw 232.14632988
CAS RN 64395-76-2
C_ID C00012879 ,
InChIKey PQRAHHQIYITFCT-GMMMMNJQNA-N
InChICode InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h5,11-13H,2,4,6-8H2,1,3H3/t11-,12+,13-,15-/m1/s1
SMILES C1(=CCC[C@]2([C@H]1C[C@H]1[C@@H](C2)OC(=O)C1=C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia iwayomogi Ref.
PlantaeAsteraceaeInula racemosa Ref.
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